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2,6-Di-tert-butyl-4-[3-hydroxy-3,3-bis(4-chlorophenyl)propynyl]-2,5-cyclohexadien-1-ol
SpectraBase Compound ID HVlG1VLJTLO
InChI InChI=1S/C29H30Cl2O2/c1-27(2,3)24-17-19(18-25(26(24)32)28(4,5)6)15-16-29(33,20-7-11-22(30)12-8-20)21-9-13-23(31)14-10-21/h7-14,17-18,32-33H,1-6H3
InChIKey USWZDMKPAMKUIW-UHFFFAOYSA-N
Mol Weight 481.46 g/mol
Molecular Formula C29H30Cl2O2
Exact Mass 480.162286 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 39nEP8W3mRt
Name 2,6-Di-tert-butyl-4-[3-hydroxy-3,3-bis(4-chlorophenyl)propynyl]-2,5-cyclohexadien-1-ol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H30Cl2O2
InChI InChI=1S/C29H30Cl2O2/c1-27(2,3)24-17-19(18-25(26(24)32)28(4,5)6)15-16-29(33,20-7-11-22(30)12-8-20)21-9-13-23(31)14-10-21/h7-14,17-18,32-33H,1-6H3
InChIKey USWZDMKPAMKUIW-UHFFFAOYSA-N
Molecular Weight 481.463 g/mol
SMILES OC(C#Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)(c1ccc(cc1)Cl)c1ccc(cc1)Cl
SPLASH splash10-001i-0000900000-2d85c8bb023a719f5541
Source of Spectrum K1-2004-3094-6
Synonyms 4-[3,3-bis(4-chlorophenyl)-3-hydroxy-1-propynyl]-2,6-ditert-butylphenol
Wiley ID 1561213